File name: Pandora21s1_Bremen_20210927_L2Fit_fout2c1d20201116p1-8.txt File generation date: 20240830T091101.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c1p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v1d20201116.txt Level 1 file used: Pandora21s1_Bremen_20210927_L1_smca1c1d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20210927 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20210927T065724.0Z 7940.289861 277 1 50.65 2 76.51 111.81 46.00 247.80 0.00 1 0.00 1 0 25 2.238e-01 8.425e-03 1.529e-01 4.858e-03 5.179172e-01 2.589957e-03 6.603772e-03 -6.000000e+00 1.329048e-01 226.95 -2.00 3.88 -2.00 320.46 0.00e+00 1.264980e-03 8.221821e-04 3.887054e-04 -6.000000e+00 5.361558e-03 277.93 -2.00 20.00 -2.00 320.15 0.00e+00 4.185 0.002 302.00 328.00 3 3.7376e+00 7.4088e-03 5.1152e-02 -6.0000e+00 3.3183e-01 9.0052e-02 9.0543e-03 3.0131e-02 -6.0000e+00 3.6086e-01 -4.7822e-02 9.1293e-03 1.5912e-02 -6.0000e+00 2.1226e-01 1.0070e-02 4.7853e-03 5.0091e-03 -6.0000e+00 8.8193e-02 1.0961e-04 -9.7324e-04 1.5512e-04 6.5749e-05 -6.0000e+00 6.7185e-03 -2.6517e-03 5.8677e-06 11 8 0 10 0 0 96.01 22.18 0.32 -0.00265 -0.00996 29 6 1 5 0 1746.329 25.28 19.99 22.18 24.92 27.3 1009.25 -37953 10211 -27912 -4074 -66618 -55423 -85830 170529 -77038 15502 -63195 -8569 -19046 28119 42004 -35213 7925 -17874 25616 -27369 7334 -31204 30544 -12445 5493 -4993 -11191 32465 -20966 17179 -20398 17748 -11708 -44 -2526 -4514 469 -14818 7906 -5085 4603 -6824 4648 1269 2313 7076 -752 549 -3112 5087 -681 7358 -658 3429 918 532 1395 1050 3024 -147 4371 -158 2602 -493 2050 44 758 913 -380 -1129 -1003 1166 -340 775 -1046 1395 -1076 -98 -112 108 -719 -1112 104 -1772 -351 -1458 -330 -208 733 1265 30 2819 -340 1852 -558 887 908 295 566 -1197 132 -420 106 -1380 -865 -1415 -1284 -466 -277 207 -468 212 -262 219 146 1067 -226 47 -276 -691 -734 -248 452 -220 960 23 1207 778 1321 339 283 555 96 492 -108 -3 -205 221 -529 -258 -42 -634 119 -404 80 -327 -38 -1030 -763 -1653 808 -1708 161 -1403 -128 -368 431 680 -1317 222 -685 707 -1284 259 -1588 919 -593 239 -251 -605 1155 -1199 718 -1345 942 -915 -3 -190 -346 37 -1577 815 -697 646 -1148 734 213 389 1154 -134 98 -592 939 -144 1579 -166 893 258 156 418 317 883 -44 1281 -52 925 -198 838 18 300 364 -165 -554 -539 647 -192 417 -535 636 -465 -41 -50 55 -424 -739 74 -1375 -285 -1272 -300 -195 684 1145 26 2227 -262 1395 -459 805 929 338 699 -1526 160 -473 110 -1450 -951 -1653 -1573 -597 -378 305 -746 352 -440 354 224 1558 -330 71 -434 -1139 -1229 -407 719 -341 1422 33 1668 1084 1959 553 499 1026 186 985 -230 -8 -467 511 -1237 -593 -93 -1350 244 SS 20210927T071330.1Z 7940.301043 284 1 49.96 2 74.30 115.28 48.20 251.71 0.00 1 0.00 1 0 25 8.130e-02 5.627e-03 7.677e-02 4.083e-03 4.562559e-01 2.161134e-03 5.857261e-03 -6.000000e+00 4.829263e-02 226.95 -2.00 3.88 -2.00 320.16 0.00e+00 3.648605e-04 6.259440e-04 2.990528e-04 -6.000000e+00 1.947539e-03 277.92 -2.00 20.00 -2.00 319.84 0.00e+00 3.630 0.001 302.00 328.00 3 3.7050e+00 6.0911e-03 4.4554e-02 -6.0000e+00 1.2058e-01 2.0709e-02 7.2293e-03 2.6346e-02 -6.0000e+00 1.3111e-01 2.2757e-02 6.7682e-03 1.3741e-02 -6.0000e+00 7.7123e-02 -2.0075e-02 3.5889e-03 4.2642e-03 -6.0000e+00 3.2053e-02 2.0959e-04 -4.6643e-04 1.3232e-04 5.4634e-05 -6.0000e+00 2.4403e-03 -3.0828e-03 6.8578e-05 10 0 0 10 0 0 99.94 22.18 0.22 -0.00308 -0.00659 113 22 1 5 0 442.060 25.28 20.00 22.18 25.43 27.6 1012.51 16739 -19598 -25834 -42988 -40041 -31203 -11562 -37164 -2936 4894 14155 178 -9388 15965 1344 7126 -8660 9567 -1089 1373 1490 -624 23130 3491 1165 -21 2815 -8294 3024 -3220 2144 6796 -1209 -5245 -5672 2437 2246 1078 -3640 1927 1305 -3748 -4136 -3374 -852 -3617 665 -1073 108 -1258 1096 2540 368 463 1915 1440 -241 1091 -1075 3128 1196 2911 1864 395 646 -53 -461 1942 1731 -247 -216 -805 0 -214 -311 420 -446 801 -42 -198 -721 -951 -1065 -1455 -602 -1217 117 -95 -14 107 696 1285 930 1127 1322 447 419 212 -361 -563 -242 23 630 193 -614 -1028 -310 -464 164 -23 -131 -412 129 228 645 469 373 179 -119 -451 -823 -471 -321 -147 -110 121 771 1343 809 17 420 -69 263 24 174 -145 190 -86 -401 -261 -192 -3 201 185 -327 -477 -899 -778 -556 -186 -824 -54 91 255 4 -254 412 46 261 -395 401 -53 69 77 -33 1041 199 73 -1 184 -585 189 -218 151 517 -109 -518 -556 222 221 124 -523 308 234 -755 -873 -724 -181 -796 142 -234 24 -292 267 666 106 143 615 483 -84 379 -377 1045 418 1074 763 178 302 -25 -205 844 806 -131 -126 -496 0 -128 -173 213 -210 364 -20 -109 -453 -669 -815 -1187 -518 -1121 112 -94 -14 103 635 1086 744 889 1105 418 440 248 -457 -724 -298 26 667 204 -690 -1229 -386 -610 228 -34 -210 -694 216 368 979 679 533 263 -184 -736 -1374 -776 -514 -228 -165 173 1061 1841 1186 27 721 -125 491 47 356 -313 422 -195 -917 -587 -418 -6 406 SS 20210927T072224.9Z 7940.307233 290 1 50.00 2 73.10 117.24 49.44 253.79 0.00 1 0.00 1 0 25 3.104e-02 4.718e-03 1.416e-02 9.441e-04 4.291298e-01 4.965938e-04 5.605183e-03 -6.000000e+00 1.843461e-02 226.95 -2.00 3.88 -2.00 319.72 0.00e+00 5.902728e-04 1.290622e-04 2.413259e-04 -6.000000e+00 7.435957e-04 277.92 -2.00 20.00 -2.00 319.41 0.00e+00 3.388 0.001 302.00 328.00 3 1.8817e+00 1.3779e-03 4.1725e-02 -6.0000e+00 4.6026e-02 3.3348e-03 1.5983e-03 2.4772e-02 -6.0000e+00 5.0051e-02 1.3480e-04 1.3877e-03 1.2737e-02 -6.0000e+00 2.9441e-02 -7.5756e-03 7.4181e-04 3.8691e-03 -6.0000e+00 1.2234e-02 1.7173e-03 -6.3853e-04 3.0166e-05 4.9927e-05 -6.0000e+00 9.3178e-04 -3.0463e-03 2.0383e-05 10 0 0 10 0 0 88.05 22.18 0.20 -0.00305 -0.00784 339 67 1 5 0 147.460 25.28 19.99 22.18 25.61 27.5 1013.42 -14932 -16214 -5425 -10892 -5656 -8392 -9554 -13696 -3421 -2723 -8102 -9201 889 -5291 -2611 -795 -2951 -382 -1836 59 -2566 -1197 -596 -1478 -332 -1828 -1209 -1754 798 128 605 963 -205 -1615 -2177 -1089 -624 -1434 -1627 -1334 -1770 -803 -1095 -556 -1055 -857 5 -566 48 365 630 591 837 708 444 924 349 427 488 916 1164 1488 1167 846 298 846 582 374 1116 191 31 36 104 -200 62 468 185 519 180 -254 -350 -1224 -1504 -1337 -969 -719 -275 -156 221 -51 473 665 1052 1127 841 795 757 427 -412 -343 -288 -383 267 206 -892 -722 -751 -460 92 -64 27 -171 8 -58 216 597 573 316 -188 -564 -768 -197 -259 -66 160 369 941 1129 650 404 300 45 163 361 -55 -188 -21 11 -290 -166 -133 -213 -16 -278 -347 -109 -226 -104 -155 -190 -321 -81 -69 -226 -282 29 -202 -115 -40 -164 -22 -116 4 -176 -82 -42 -113 -27 -158 -105 -149 64 11 54 98 -23 -196 -261 -129 -80 -216 -275 -265 -395 -190 -272 -140 -270 -221 1 -146 12 98 182 186 284 257 170 366 142 175 197 364 474 650 563 445 163 446 294 189 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